6-[2-(cyclopropylmethylamino)-4-pyridinyl]-N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]-6-[[6-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)-3-pyridinyl]methyl]pyridine-2-carboxamide;N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)-6-pyridin-4-ylpyridine-2-carboxamide

C75H74F3N21O5 — CID 159030856

IUPAC6-[2-(cyclopropylmethylamino)-4-pyridinyl]-N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]-6-[[6-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)-3-pyridinyl]methyl]pyridine-2-carboxamide;N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)-6-pyridin-4-ylpyridine-2-carboxamide
SMILESCOCCOCCn1cc(NC(=O)c2cccc(Cc3cnc(N4CCN(C)CC4)c(C(F)(F)F)c3)n2)c(-c2ccccn2)n1.Cn1cc(NC(=O)c2cccc(-c3ccnc(NCC4CC4)c3)n2)c(-c2ccccn2)n1.Cn1cc(NC(=O)c2cccc(-c3ccncc3)n2)c(-c2ccccn2)n1
InChIInChI=1S/C31H35F3N8O3.C24H23N7O.C20H16N6O/c1-40-10-12-41(13-11-40)29-24(31(32,33)34)19-22(20-36-29)18-23-6-5-8-26(37-23)30(43)38-27-21-42(14-15-45-17-16-44-2)39-28(27)25-7-3-4-9-35-25;1-31-15-21(23(30-31)19-5-2-3-11-25-19)29-24(32)20-7-4-6-18(28-20)17-10-12-26-22(13-17)27-14-16-8-9-16;1-26-13-18(19(25-26)16-5-2-3-10-22-16)24-20(27)17-7-4-6-15(23-17)14-8-11-21-12-9-14/h3-9,19-21H,10-18H2,1-2H3,(H,38,43);2-7,10-13,15-16H,8-9,14H2,1H3,(H,26,27)(H,29,32);2-13H,1H3,(H,24,27)
InChIKeyJUWCIIVZKPGWGD-UHFFFAOYSA-N
MW1406.55 g/mol
LogP11.22
Rot. Bonds23

About 6-[2-(cyclopropylmethylamino)-4-pyridinyl]-N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]-6-[[6-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)-3-pyridinyl]methyl]pyridine-2-carboxamide;N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)-6-pyridin-4-ylpyridine-2-carboxamide

6-[2-(cyclopropylmethylamino)-4-pyridinyl]-N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]-6-[[6-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)-3-pyridinyl]methyl]pyridine-2-carboxamide;N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)-6-pyridin-4-ylpyridine-2-carboxamide (PubChem CID 159030856) has the molecular formula C75H74F3N21O5 and a molecular weight of 1406.55 g/mol. Its IUPAC name is 6-[2-(cyclopropylmethylamino)-4-pyridinyl]-N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]-6-[[6-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)-3-pyridinyl]methyl]pyridine-2-carboxamide;N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)-6-pyridin-4-ylpyridine-2-carboxamide.

Molecular Properties

Compound Name6-[2-(cyclopropylmethylamino)-4-pyridinyl]-N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]-6-[[6-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)-3-pyridinyl]methyl]pyridine-2-carboxamide;N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)-6-pyridin-4-ylpyridine-2-carboxamide
PubChem CID159030856
Molecular FormulaC75H74F3N21O5
Molecular Weight1406.55 g/mol
Exact Mass1405.61
IUPAC Name6-[2-(cyclopropylmethylamino)-4-pyridinyl]-N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]-6-[[6-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)-3-pyridinyl]methyl]pyridine-2-carboxamide;N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)-6-pyridin-4-ylpyridine-2-carboxamide
SMILESCOCCOCCn1cc(NC(=O)c2cccc(Cc3cnc(N4CCN(C)CC4)c(C(F)(F)F)c3)n2)c(-c2ccccn2)n1.Cn1cc(NC(=O)c2cccc(-c3ccnc(NCC4CC4)c3)n2)c(-c2ccccn2)n1.Cn1cc(NC(=O)c2cccc(-c3ccncc3)n2)c(-c2ccccn2)n1
InChIInChI=1S/C31H35F3N8O3.C24H23N7O.C20H16N6O/c1-40-10-12-41(13-11-40)29-24(31(32,33)34)19-22(20-36-29)18-23-6-5-8-26(37-23)30(43)38-27-21-42(14-15-45-17-16-44-2)39-28(27)25-7-3-4-9-35-25;1-31-15-21(23(30-31)19-5-2-3-11-25-19)29-24(32)20-7-4-6-18(28-20)17-10-12-26-22(13-17)27-14-16-8-9-16;1-26-13-18(19(25-26)16-5-2-3-10-22-16)24-20(27)17-7-4-6-15(23-17)14-8-11-21-12-9-14/h3-9,19-21H,10-18H2,1-2H3,(H,38,43);2-7,10-13,15-16H,8-9,14H2,1H3,(H,26,27)(H,29,32);2-13H,1H3,(H,24,27)
InChIKeyJUWCIIVZKPGWGD-UHFFFAOYSA-N
XLogP11.22
TPSA293.74 Ų
H-Bond Donors4
H-Bond Acceptors23
Rotatable Bonds23
Heavy Atoms104
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001406.55
LogP ≤ 511.22
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1023

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 6-[2-(cyclopropylmethylamino)-4-pyridinyl]-N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]-6-[[6-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)-3-pyridinyl]methyl]pyridine-2-carboxamide;N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)-6-pyridin-4-ylpyridine-2-carboxamide with MolForge

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Launch Full Analysis

Related Compounds

6-cyclopropyl-N-[1-(2-morpholin-4-ylethyl)-3-pyridin-2-ylpyrazol-5-yl]-3-(pyrimidin-5-ylamino)pyridine-2-carboxamide
CID 53328633
2,5-dimethyl-N-[2-(2-piperazin-1-yl-4-pyridinyl)-6-(pyrazin-2-ylamino)-4-pyridinyl]pyrazole-3-carboxamide
CID 67128132
N-[2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-5-(trifluoromethyl)-4-pyridinyl]-6-(1-methylpyrazol-4-yl)pyridine-2-carboxamide
CID 165129756
N-[2-[(3S)-3-methyl-4-(oxetan-3-yl)piperazin-1-yl]-5-(trifluoromethyl)-4-pyridinyl]-6-(1-methylpyrazol-4-yl)pyridine-2-carboxamide
CID 165129767
N-[2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-5-methyl-4-pyridinyl]-6-(1-methylpyrazol-4-yl)pyridine-2-carboxamide
CID 165129879
N-[6-[5-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-3-(4-fluorophenyl)-1-methylpyrazol-4-yl]imidazo[1,2-b]pyridazin-2-yl]-2-morpholin-4-ylpyridine-4-carboxamide
CID 75593277
N-[6-[3-(4-fluorophenyl)-1-methyl-5-piperidin-4-ylpyrazol-4-yl]imidazo[1,2-b]pyridazin-2-yl]-2-morpholin-4-ylpyridine-4-carboxamide
CID 90241277
N-[6-[3-(4-fluorophenyl)-5-[1-(3-fluoropropyl)piperidin-4-yl]-1-methylpyrazol-4-yl]imidazo[1,2-b]pyridazin-2-yl]-2-morpholin-4-ylpyridine-4-carboxamide
CID 90241963
N-[6-methyl-5-(8-morpholin-4-ylimidazo[1,2-b]pyridazin-6-yl)pyridin-3-yl]-4-(trifluoromethyl)pyridine-2-carboxamide
CID 90456083
2-(1,1-difluoropropyl)-N-[6-methyl-5-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)pyridin-3-yl]pyridine-4-carboxamide
CID 90462946
N-[6-methyl-5-(7-morpholin-4-ylpyrazolo[1,5-a]pyrimidin-5-yl)pyridin-3-yl]-4-(trifluoromethyl)pyridine-2-carboxamide
CID 117609948
US9586948, Example 23
CID 117872334

Frequently Asked Questions

What is the IUPAC name of 6-[2-(cyclopropylmethylamino)-4-pyridinyl]-N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]-6-[[6-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)-3-pyridinyl]methyl]pyridine-2-carboxamide;N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)-6-pyridin-4-ylpyridine-2-carboxamide?
The IUPAC name of 6-[2-(cyclopropylmethylamino)-4-pyridinyl]-N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]-6-[[6-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)-3-pyridinyl]methyl]pyridine-2-carboxamide;N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)-6-pyridin-4-ylpyridine-2-carboxamide (CID 159030856) is 6-[2-(cyclopropylmethylamino)-4-pyridinyl]-N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]-6-[[6-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)-3-pyridinyl]methyl]pyridine-2-carboxamide;N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)-6-pyridin-4-ylpyridine-2-carboxamide.
What is the SMILES notation for 6-[2-(cyclopropylmethylamino)-4-pyridinyl]-N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]-6-[[6-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)-3-pyridinyl]methyl]pyridine-2-carboxamide;N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)-6-pyridin-4-ylpyridine-2-carboxamide?
The canonical SMILES for 6-[2-(cyclopropylmethylamino)-4-pyridinyl]-N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]-6-[[6-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)-3-pyridinyl]methyl]pyridine-2-carboxamide;N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)-6-pyridin-4-ylpyridine-2-carboxamide is COCCOCCn1cc(NC(=O)c2cccc(Cc3cnc(N4CCN(C)CC4)c(C(F)(F)F)c3)n2)c(-c2ccccn2)n1.Cn1cc(NC(=O)c2cccc(-c3ccnc(NCC4CC4)c3)n2)c(-c2ccccn2)n1.Cn1cc(NC(=O)c2cccc(-c3ccncc3)n2)c(-c2ccccn2)n1.
What is the InChIKey of 6-[2-(cyclopropylmethylamino)-4-pyridinyl]-N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]-6-[[6-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)-3-pyridinyl]methyl]pyridine-2-carboxamide;N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)-6-pyridin-4-ylpyridine-2-carboxamide?
The InChIKey is JUWCIIVZKPGWGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H35F3N8O3.C24H23N7O.C20H16N6O/c1-40-10-12-41(13-11-40)29-24(31(32,33)34)19-22(20-36-29)18-23-6-5-8-26(37-23)30(43)38-27-21-42(14-15-45-17-16-44-2)39-28(27)25-7-3-4-9-35-25;1-31-15-21(23(30-31)19-5-2-3-11-25-19)29-24(32)20-7-4-6-18(28-20)17-10-12-26-22(13-17)27-14-16-8-9-16;1-26-13-18(19(25-26)16-5-2-3-10-22-16)24-20(27)17-7-4-6-15(23-17)14-8-11-21-12-9-14/h3-9,19-21H,10-18H2,1-2H3,(H,38,43);2-7,10-13,15-16H,8-9,14H2,1H3,(H,26,27)(H,29,32);2-13H,1H3,(H,24,27).
What are the key properties of 6-[2-(cyclopropylmethylamino)-4-pyridinyl]-N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]-6-[[6-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)-3-pyridinyl]methyl]pyridine-2-carboxamide;N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)-6-pyridin-4-ylpyridine-2-carboxamide?
6-[2-(cyclopropylmethylamino)-4-pyridinyl]-N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]-6-[[6-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)-3-pyridinyl]methyl]pyridine-2-carboxamide;N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)-6-pyridin-4-ylpyridine-2-carboxamide has a molecular weight of 1406.55 g/mol, XLogP of 11.22, 23 rotatable bonds, 4 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(cyclopropylmethylamino)-4-pyridinyl]-N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)pyridine-2-carboxamide;N-[1-[2-(2-methoxyethoxy)ethyl]-3-pyridin-2-ylpyrazol-4-yl]-6-[[6-(4-methylpiperazin-1-yl)-5-(trifluoromethyl)-3-pyridinyl]methyl]pyridine-2-carboxamide;N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)-6-pyridin-4-ylpyridine-2-carboxamide is sourced from PubChem (CID 159030856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).